Symmetry-projected spin-AGP methods applied to spin systems
Abstract
Symmetry-projected wave function methods capture static correlation by breaking and restoring the symmetries of a system. In this article, we present the symmetry-projected spin antisymmetrized geminal power (spin-AGP) state projected onto space group symmetry as well as complex conjugation, spin-flip, and time-reversal symmetries. The method is benchmarked on the 1D XXZ model and the 2D J1 − J2 model with square and triangular lattices. Our results indicate that symmetry projection methods provide a powerful tool for frustrated spin systems.
Article Details
Journal Info
The Journal of Chemical Physics
American Institute of Physics
Authors (3)
Zhiyuan Liu
Thomas M. Henderson
Department of Chemistry, Rice University 1 , Houston, Texas 77005-1892,
Gustavo E. Scuseria
Department of Chemistry, Rice University 1 , Houston, Texas 77005-1892,